Molecule

ID:112797

General Information
Structure
MolImage
Molecular Formula
Al₂H₆O₁₂Se₃
Molecular Mass
488.883516
Exact Mass
491.69856589
Charge
0
InChI
InChI=1S/2Al.3H2O4Se/c;;3*1-5(2,3)4/h;;3*(H2,1,2,3,4)/q2*+3;;;/p-6
InChIKey
JSMYWMXSQDUVSJ-UHFFFAOYSA-H
Canonic Smiles
[O-][Se](=O)(=O)[O-].[O-][Se](=O)(=O)[O-].[O-][Se](=O)(=O)[O-].[AlH3+3].[AlH3+3]
Isomeric Smiles
[AlH3+3].[AlH3+3].[O-][Se](=O)(=O)[O-].[O-][Se](=O)(=O)[O-].[O-][Se](=O)(=O)[O-]
Calculated Properties
JChem
Acid pKa
10.281616
H Acceptors
4
H Donor
0
LogD (pH = 5.5)
-1.6279072
LogD (pH = 7.4)
-1.6284668
Log P
-1.6279
Molar Refractivity
18.8865
Polarizability
4.39116
Polar Surface Area
80.26
Rotatable Bonds
0
Lipinski's Rule of Five
true
Data Source
Names and Identifiers
Registration numbers
Properties
Related Proteins
No Data Available
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Molecular Spectra
No Data Available
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Molecule Details
References
Bioactivity
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